Adsorption of an Mn atom on a ZnO sheet and nanotube: A density functional theory study

Journal of Physics Condensed Matter

Volumn 22, Issue 17, 2010, Pages

  He, A L ^a,b   Wang, X Q ^a   Wu, R Q ^b   Lu, Y H ^b   Feng, Y P ^b  

^a CHONGQING UNIVERSITY   (China)

^b NATIONAL UNIVERSITY OF SINGAPORE   (Singapore)

Author keywords

[No Author keywords available]

Indexed keywords

A-DENSITY; ADSORPTION BEHAVIOR; FIRST-PRINCIPLES CALCULATION; MN ATOMS; ORBITALS; OXYGEN SITE; SINGLE-WALL; ZNO; ZNO NANOTUBE;

ADSORPTION; BINDING ENERGY; DENSITY FUNCTIONAL THEORY; ELECTRONIC STRUCTURE; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; MANGANESE; MANGANESE COMPOUNDS; NANOTUBES; NUCLEAR ENERGY; OXYGEN; POTENTIAL ENERGY; ZINC OXIDE;

ATOMS;

EID: 77950851141     PISSN: 09538984     EISSN: 1361648X     Source Type: Journal    
DOI: 10.1088/0953-8984/22/17/175501     Document Type: Article

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